2-N-cyclopentyl-2-N-ethyl-1-(4-ethylphenyl)-1-N-methylpropane-1,2-diamine

C19H32N2 — CID 63468460

IUPAC2-N-cyclopentyl-2-N-ethyl-1-(4-ethylphenyl)-1-N-methylpropane-1,2-diamine
SMILESCCc1ccc(C(NC)C(C)N(CC)C2CCCC2)cc1
InChIInChI=1S/C19H32N2/c1-5-16-11-13-17(14-12-16)19(20-4)15(3)21(6-2)18-9-7-8-10-18/h11-15,18-20H,5-10H2,1-4H3
InChIKeyUOFSRLBZXQCLQJ-UHFFFAOYSA-N
MW288.48 g/mol
LogP4.16
Rot. Bonds7

About 2-N-cyclopentyl-2-N-ethyl-1-(4-ethylphenyl)-1-N-methylpropane-1,2-diamine

2-N-cyclopentyl-2-N-ethyl-1-(4-ethylphenyl)-1-N-methylpropane-1,2-diamine (PubChem CID 63468460) has the molecular formula C19H32N2 and a molecular weight of 288.48 g/mol. Its IUPAC name is 2-N-cyclopentyl-2-N-ethyl-1-(4-ethylphenyl)-1-N-methylpropane-1,2-diamine.

Molecular Properties

Compound Name2-N-cyclopentyl-2-N-ethyl-1-(4-ethylphenyl)-1-N-methylpropane-1,2-diamine
PubChem CID63468460
Molecular FormulaC19H32N2
Molecular Weight288.48 g/mol
Exact Mass288.26
IUPAC Name2-N-cyclopentyl-2-N-ethyl-1-(4-ethylphenyl)-1-N-methylpropane-1,2-diamine
SMILESCCc1ccc(C(NC)C(C)N(CC)C2CCCC2)cc1
InChIInChI=1S/C19H32N2/c1-5-16-11-13-17(14-12-16)19(20-4)15(3)21(6-2)18-9-7-8-10-18/h11-15,18-20H,5-10H2,1-4H3
InChIKeyUOFSRLBZXQCLQJ-UHFFFAOYSA-N
XLogP4.16
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.48
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-N-ethyl-1-(4-ethylphenyl)ethane-1,2-diamine
CID 43078748
1-(4-ethylphenyl)-1-N,2-N-dimethyl-2-N-(4-methylpentan-2-yl)propane-1,2-diamine
CID 63467800
1-(4-ethylphenyl)-2-(3-methoxypiperidin-1-yl)-N-methylpropan-1-amine
CID 102965616
1-(4-ethylphenyl)-1-N-methylpropane-1,2-diamine
CID 116948027
1-(4-ethylphenyl)-1-N,2-N-dimethyl-2-N-(2-methylbutan-2-yl)propane-1,2-diamine
CID 63982925
1-cyclopentyl-1-(4-ethylphenyl)-N-methylmethanamine
CID 43484724
N-ethyl-N-[1-(4-ethylphenyl)ethyl]piperidin-3-amine
CID 63644319
N-[2-chloro-2-(4-ethylphenyl)ethyl]-N-methylcyclohexanamine
CID 82214367
N'-cyclopentyl-N-[1-(4-ethylphenyl)ethyl]-N'-methylethane-1,2-diamine
CID 63314482
1-(4-ethylphenyl)-N-methyl-2-(4-methylazepan-1-yl)propan-1-amine
CID 63624077
2-cyclobutyloxy-1-(4-ethylphenyl)-N-methylethanamine
CID 62139676
2-cycloheptyl-1-(4-ethylphenyl)-N-methylethanamine
CID 114457545

Frequently Asked Questions

What is the IUPAC name of 2-N-cyclopentyl-2-N-ethyl-1-(4-ethylphenyl)-1-N-methylpropane-1,2-diamine?
The IUPAC name of 2-N-cyclopentyl-2-N-ethyl-1-(4-ethylphenyl)-1-N-methylpropane-1,2-diamine (CID 63468460) is 2-N-cyclopentyl-2-N-ethyl-1-(4-ethylphenyl)-1-N-methylpropane-1,2-diamine.
What is the SMILES notation for 2-N-cyclopentyl-2-N-ethyl-1-(4-ethylphenyl)-1-N-methylpropane-1,2-diamine?
The canonical SMILES for 2-N-cyclopentyl-2-N-ethyl-1-(4-ethylphenyl)-1-N-methylpropane-1,2-diamine is CCc1ccc(C(NC)C(C)N(CC)C2CCCC2)cc1.
What is the InChIKey of 2-N-cyclopentyl-2-N-ethyl-1-(4-ethylphenyl)-1-N-methylpropane-1,2-diamine?
The InChIKey is UOFSRLBZXQCLQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2/c1-5-16-11-13-17(14-12-16)19(20-4)15(3)21(6-2)18-9-7-8-10-18/h11-15,18-20H,5-10H2,1-4H3.
What are the key properties of 2-N-cyclopentyl-2-N-ethyl-1-(4-ethylphenyl)-1-N-methylpropane-1,2-diamine?
2-N-cyclopentyl-2-N-ethyl-1-(4-ethylphenyl)-1-N-methylpropane-1,2-diamine has a molecular weight of 288.48 g/mol, XLogP of 4.16, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclopentyl-2-N-ethyl-1-(4-ethylphenyl)-1-N-methylpropane-1,2-diamine is sourced from PubChem (CID 63468460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).